Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 4/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7522643 | 0.82 | ALDH1A1 (0.34) | POLBESR1ESR2PKMTHRB | |
| SCHEMBL7521223 | 0.82 | HPGD (0.34) | ESR1ESR2THRB | |
| SCHEMBL7529328 | 0.79 | CYP3A4 (0.46) | POLBESR1ESR2 | |
| SCHEMBL7526887 | 0.78 | ALDH1A1 (0.34) | POLBESR1ESR2THRB | |
| SCHEMBL7524452 | 0.73 | ESR1 (0.36) | POLBESR1ESR2PKMTHRB | |
| SCHEMBL7518323 | 0.72 | ESR1 (0.36) | ESR1ESR2SLC6A9PKM | |
| SCHEMBL7457498 | 0.72 | ESR1 (0.39) | ESR1ESR2PKMTHRB | |
| SCHEMBL7789796 | 0.72 | ESR1 (0.38) | ESR1ESR2PKM | |
| SCHEMBL7518004 | 0.68 | ESR1 (0.39) | POLBESR1ESR2PKM | |
| SCHEMBL7521814 | 0.67 | HPGD (0.38) | ESR1ESR2THRB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1003747-A4 | CARBAPENEMS WITH NAPHTHOSULTAM DERIVATIVE LINKED VIA METHYLENE | MERCK & CO INC (US) | 2002-11-06 | — | — | EP | disclosed |
| US-6251890-B1 | TREATING OR PREVENTING BACTERIAL INFECTIONS IN MAMMALIAN PATIENTS | MERCK & CO., INC. | 2001-06-26 | — | — | US | disclosed |
| EP-1003747-A1 | CARBAPENEMS WITH NAPHTHOSULTAM DERIVATIVE LINKED VIA METHYLENE | Merck & Co., Inc. (US) | 2000-05-31 | — | — | EP | disclosed |
| WO-1999009032-A1 | CARBAPENEMS WITH NAPHTHOSULTAM DERIVATIVE LINKED VIA METHYLENE | MERCK & CO., INC. (US) | 1999-02-25 | — | — | WO | disclosed |